NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3394 8.1233 123.5634 51.6035 20.1256 177.7817 2 L 3.9960 8.4914 122.4779 56.0499 41.4459 174.7264 3 V 3.6473 8.6348 120.1536 64.9951 31.4376 177.8640 4 N 4.4416 7.9053 116.5323 55.9402 38.3712 176.9259 5 F 4.5597 8.1749 121.9387 61.9542 39.5182 176.9352 6 H 4.0503 8.7309 116.1579 58.7711 28.4917 177.8244 7 R 4.0020 7.9733 120.8953 59.5150 29.9183 178.2547 8 M 4.0915 8.1156 118.2122 58.6346 32.1431 178.3187 9 I 3.5850 7.7521 120.2148 64.2350 37.2374 178.5191 10 K 4.2096 8.0152 120.7204 58.6596 31.6047 179.1244 11 L 3.9771 7.5866 119.4475 58.5547 42.2147 178.9397 12 T 4.0890 7.8282 108.5572 64.1448 68.9479 175.7620 13 T 4.4027 8.1767 110.8665 60.7262 70.1503 175.8624 14 G 3.9202 8.1162 108.4896 45.2048 0.0000 173.2525 15 K 4.4094 7.5982 119.2388 54.4629 34.1349 175.8340 16 E 4.2146 8.5093 120.6981 56.1723 29.9013 177.5311 17 A 4.0032 8.7446 126.7472 55.7372 18.3774 178.2448 18 A 3.7941 8.0528 117.8951 55.8822 18.0612 179.5470 19 L 4.1655 7.7588 115.7908 58.1780 42.0676 179.7846 20 S 4.2498 7.8630 114.9345 60.0662 63.2537 174.6362 21 Y 4.6625 8.3113 116.4585 57.1193 39.8979 177.6685 22 G 3.4596 8.2584 110.0907 47.8241 0.0000 175.1284 23 F 5.1074 7.9372 115.5816 56.8227 40.4756 173.7866 24 Y 4.1875 7.9767 122.7087 58.7991 39.5924 176.5098 25 G 3.6155 7.9812 116.4050 47.0943 0.0000 173.2257 26 C 5.0274 9.6826 117.4284 57.3863 41.1271 174.7617 27 H 4.5340 8.3231 114.4408 55.7487 30.8655 173.5784 28 C 4.5245 8.0778 116.5500 57.8422 40.6635 174.4883 29 G 4.0712 8.6449 109.3307 45.5026 0.0000 172.6429 30 V 3.6081 8.0183 118.5223 63.9731 32.2396 177.5470 31 G 3.7976 8.0557 115.0109 45.3482 0.0000 171.0480 32 G 4.0545 7.6791 106.2301 44.1176 0.0000 172.4382 33 R 4.3647 8.0957 118.2305 56.1002 32.5453 176.5121 34 G 4.3425 8.4978 107.3492 45.4284 0.0000 172.8374 35 S 4.4853 8.3450 115.8557 56.8786 63.6631 172.7411 36 P 4.5906 0.0000 0.0000 62.7612 31.7515 176.7458 37 K 3.7552 8.6605 120.3176 59.1045 32.5458 176.1850 38 D 4.4709 7.2535 115.3671 51.6000 41.8660 175.1767 39 A 4.0216 8.7077 119.6493 56.0612 18.3959 179.8898 40 T 3.9492 8.0298 113.7271 66.9715 68.6694 176.1745 41 D 4.6024 8.8564 120.0705 57.4274 41.2757 178.4895 42 R 3.9968 8.1167 118.4935 59.0371 30.0027 178.3212 43 C 4.3014 8.0525 116.3754 60.1204 41.3315 175.2097 44 C 4.1568 7.9309 116.6424 59.1244 36.6630 176.3188 45 V 3.4569 7.5426 120.3189 66.1270 31.1538 178.0979 46 T 3.8046 7.7408 109.5134 64.7621 68.3992 176.1446 47 Q 3.7501 7.8598 122.2621 59.0398 28.9978 178.0435 48 D 4.1055 8.0066 119.8060 57.4543 40.7720 178.2040 49 C 4.2956 8.1357 117.2145 59.9588 34.7642 175.3055 50 C 4.2374 8.1502 120.1656 59.9404 42.7556 175.2774 51 Y 4.0064 8.4431 118.7073 60.7437 37.3134 178.2646 52 K 4.3755 8.3563 122.1104 59.0074 32.0926 178.3432 53 R 3.8675 7.6638 117.4964 59.7331 30.1794 177.7790 54 L 4.1003 7.6696 118.0170 58.0294 41.7872 179.4712 55 E 4.1320 8.4538 118.6669 59.4391 29.1576 179.6331 56 K 4.0846 8.2196 117.7153 58.9027 32.1527 178.7388 57 R 4.2402 7.6523 116.6547 56.6109 30.3772 177.0556 58 G 4.0151 8.0105 107.0943 45.4817 0.0000 173.4405 59 C 4.4337 7.8882 115.9740 56.9135 40.8032 172.9048 60 G 4.1290 8.3856 109.6735 44.2888 0.0000 173.0983 61 T 4.0960 8.2971 114.0265 61.3510 69.0366 175.8837 62 K 3.8599 7.2774 122.1291 57.6608 32.6170 177.1252 63 F 4.7169 7.5624 116.6577 57.0354 39.6581 175.6779 64 L 4.0949 7.7451 124.0178 54.7240 41.8200 176.8743 65 S 4.5035 8.7084 120.6465 57.7576 63.9995 172.3651 66 Y 4.9581 7.5651 117.7565 55.8728 40.7495 173.4327 67 K 4.9142 9.4793 122.2106 54.7631 34.4466 174.8388 68 F 5.5685 8.5203 120.8337 55.8312 41.3328 172.7943 69 S 4.7487 9.1938 113.9201 56.8802 66.9872 172.0792 70 N 5.6676 8.5622 115.9945 51.3972 40.6800 174.5376 71 S 4.4528 8.7366 114.6628 57.2785 65.5487 173.7561 72 G 3.8660 8.5115 117.1860 46.9977 0.0000 173.5300 73 S 4.5334 8.6951 119.7326 57.9111 63.6886 173.8569 74 R 4.2786 7.9356 123.2469 55.8274 30.5090 174.7645 75 I 5.0818 8.2026 125.8595 60.0090 39.5275 174.9211 76 T 4.6143 8.9366 120.4749 60.4672 70.3384 171.9515 77 C 5.0630 8.9280 126.4070 56.2770 41.1268 173.5949 78 A 4.3095 8.5751 125.8806 51.6500 19.3442 177.1338 79 K 4.2478 8.4819 119.1046 55.6924 32.0929 176.4625 80 Q 4.5098 8.1350 121.8077 53.6482 31.4406 174.2644 81 D 4.4602 8.6393 117.0689 53.8417 40.9239 176.6772 82 S 4.0440 8.7425 116.3182 62.2084 62.3604 177.4956 83 C 4.2422 8.1067 118.2946 60.2239 40.2686 176.5098 84 R 3.9290 7.8951 119.0829 59.1094 29.7432 178.9080 85 S 4.0176 8.2896 113.1476 61.6066 62.4526 176.3142 86 Q 3.9371 8.4209 121.1607 58.6557 28.3643 178.5686 87 L 3.7249 7.7096 121.3456 58.1245 42.1055 178.0783 88 C 2.7411 7.6844 118.3448 59.3400 42.5220 175.4980 89 E 3.7779 7.9010 120.0445 59.3009 28.9474 178.7081 90 C 4.2130 7.8927 116.6736 60.1516 37.4850 175.9515 91 D 3.9382 7.8868 120.3989 56.9492 40.3959 178.5597 92 K 3.7074 8.2159 120.3764 59.5448 32.1399 178.5836 93 A 3.8859 7.8940 120.6049 54.9594 18.2231 179.4912 94 A 3.5353 7.7004 118.9475 55.1961 18.4834 179.7314 95 A 3.6880 8.3292 119.6712 55.5115 18.3092 180.0522 96 T 3.7745 7.8417 114.2728 66.8023 68.2893 176.0459 97 C 4.1821 7.9144 119.3757 59.6281 38.6087 175.3400 98 F 4.6072 8.0849 119.0943 60.7556 38.3910 177.4670 99 A 4.0717 7.9981 120.2007 55.2792 18.0266 179.4603 100 R 4.2445 8.2235 114.2952 57.7432 30.4692 177.0519 101 N 5.0931 7.8177 115.7653 52.6671 40.0759 176.3360 102 K 4.1525 8.0784 122.9292 59.5838 32.4656 179.2724 103 T 3.9482 8.0902 115.0068 66.1247 68.4273 174.7932 104 T 4.4666 7.6400 108.5315 61.0815 69.0360 174.0710 105 Y 4.0338 7.8445 124.7819 58.1179 39.3804 174.3966 106 N 5.1704 8.6659 125.2509 51.2601 41.4426 175.0147 107 K 4.0452 8.6641 124.6795 58.6541 32.9021 178.6429 108 K 3.8559 8.3113 121.1722 58.6720 32.1835 176.6211 109 Y 4.6434 7.2781 114.6286 57.4220 38.8759 177.0286 110 Q 3.6911 7.4903 121.9150 58.9078 29.4715 177.1992 111 Y 5.0944 7.3852 111.4717 57.0416 38.1636 175.5180 112 Y 4.2318 7.8029 120.0650 56.6442 40.1849 174.7323 113 S 4.3834 7.8068 122.0769 57.3338 64.3111 174.8893 114 N 4.2769 8.9107 120.9811 56.1890 38.6535 176.9872 115 K 3.9526 7.7394 118.8091 59.4670 32.2925 177.4198 116 H 4.5893 7.8547 113.5759 57.0950 29.1718 176.3509 117 C 4.6617 7.6261 117.4752 57.2139 40.2810 173.0178 118 R 4.6247 7.9504 119.8185 55.6188 34.1644 176.1463 119 G 4.0054 8.5438 108.7104 45.0569 0.0000 172.7473 120 S 4.8188 8.0867 113.0917 56.5004 65.2410 173.4944 121 T 4.3758 8.0414 115.2776 61.3499 67.7344 171.8150 122 P 4.7577 0.0000 0.0000 62.3014 31.7942 173.1099 123 R 3.5164 8.3790 122.5356 56.9721 31.0747 175.2285 124 C 4.4556 8.7955 119.8807 57.4519 41.1592 173.4889 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 A 8.12 4.34 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2 L 8.49 4.00 0.00 1.82 1.68 0.86 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 3 V 8.63 3.65 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.96 0.00 0.00 4 N 7.91 4.44 0.00 2.50 2.69 0.00 0.00 6.77 8.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 F 8.17 4.56 0.00 3.32 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 H 8.73 4.05 0.00 3.21 3.32 0.00 5.69 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 R 7.97 4.00 0.00 1.96 2.36 0.00 3.19 0.00 0.00 3.11 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.73 0.00 8 M 8.12 4.09 0.00 2.14 2.10 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 2.39 0.00 9 I 7.75 3.58 1.80 0.00 0.00 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 -0.21 0.72 0.00 0.00 10 K 8.02 4.21 0.00 2.00 1.88 0.00 1.71 0.00 0.00 1.69 0.00 0.00 2.92 0.00 0.00 3.28 0.00 0.00 0.00 0.00 1.61 1.49 7.81 11 L 7.59 3.98 0.00 1.73 1.98 0.97 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 12 T 7.83 4.09 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 13 T 8.18 4.40 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 14 G 8.12 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 K 7.60 4.41 0.00 1.85 1.62 0.00 1.51 0.00 0.00 1.55 0.00 0.00 2.79 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.46 1.27 7.81 16 E 8.51 4.21 0.00 1.98 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.33 0.00 17 A 8.74 4.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 A 8.05 3.79 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 L 7.76 4.17 0.00 1.68 1.91 0.98 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 20 S 7.86 4.25 0.00 3.75 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 Y 8.31 4.66 0.00 2.87 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 G 8.26 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 F 7.94 5.11 0.00 3.48 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 Y 7.98 4.19 0.00 3.00 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 G 7.98 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 C 9.68 5.03 0.00 3.05 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 H 8.32 4.53 0.00 3.39 3.31 0.00 5.65 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 C 8.08 4.52 0.00 3.32 3.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 G 8.64 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 V 8.02 3.61 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.96 0.00 0.00 31 G 8.06 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 G 7.68 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 R 8.10 4.36 0.00 1.89 1.86 0.00 3.16 0.00 0.00 3.24 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.54 0.00 34 G 8.50 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 S 8.35 4.49 0.00 3.84 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 P 0.00 4.59 0.00 2.13 1.98 0.00 3.74 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.93 0.00 37 K 8.66 3.76 0.00 0.87 0.74 0.00 1.43 0.00 0.00 1.23 0.00 0.00 2.39 0.00 0.00 2.54 0.00 0.00 0.00 0.00 0.99 0.21 7.81 38 D 7.25 4.47 0.00 2.92 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 A 8.71 4.02 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 T 8.03 3.95 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.62 0.00 0.00 41 D 8.86 4.60 0.00 2.99 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 R 8.12 4.00 0.00 2.09 1.95 0.00 3.18 0.00 0.00 3.15 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.87 0.00 43 C 8.05 4.30 0.00 3.38 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 C 7.93 4.16 0.00 3.35 3.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 V 7.54 3.46 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.66 0.00 0.00 46 T 7.74 3.80 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 47 Q 7.86 3.75 0.00 1.98 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.83 0.00 0.00 0.00 0.00 0.00 1.42 1.94 0.00 48 D 8.01 4.11 0.00 2.82 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 C 8.14 4.30 0.00 3.16 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 C 8.15 4.24 0.00 3.16 3.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 Y 8.44 4.01 0.00 3.08 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 K 8.36 4.38 0.00 1.98 2.00 0.00 1.73 0.00 0.00 1.68 0.00 0.00 2.90 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.33 7.81 53 R 7.66 3.87 0.00 1.96 2.19 0.00 3.36 0.00 0.00 3.21 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.75 0.00 54 L 7.67 4.10 0.00 1.82 1.61 0.73 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 55 E 8.45 4.13 0.00 2.15 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.58 0.00 56 K 8.22 4.08 0.00 1.85 1.88 0.00 1.70 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.48 1.48 7.81 57 R 7.65 4.24 0.00 1.88 1.96 0.00 3.11 0.00 0.00 3.21 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.62 0.00 58 G 8.01 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 C 7.89 4.43 0.00 3.05 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 G 8.39 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 T 8.30 4.10 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 62 K 7.28 3.86 0.00 1.55 1.27 0.00 1.65 0.00 0.00 1.67 0.00 0.00 2.80 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.36 1.35 7.81 63 F 7.56 4.72 0.00 3.08 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 L 7.75 4.09 0.00 1.75 1.59 0.95 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 65 S 8.71 4.50 0.00 3.96 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 Y 7.57 4.96 0.00 3.20 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 K 9.48 4.91 0.00 1.87 1.76 0.00 1.66 0.00 0.00 1.71 0.00 0.00 2.86 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.34 1.51 7.81 68 F 8.52 5.57 0.00 3.23 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 S 9.19 4.75 0.00 3.84 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 N 8.56 5.67 0.00 2.88 2.95 0.00 0.00 5.75 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 S 8.74 4.45 0.00 3.99 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 G 8.51 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 S 8.70 4.53 0.00 3.99 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 R 7.94 4.28 0.00 1.95 2.03 0.00 3.12 0.00 0.00 3.17 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.66 0.00 75 I 8.20 5.08 1.85 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.76 0.95 0.00 0.00 76 T 8.94 4.61 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 77 C 8.93 5.06 0.00 2.98 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 A 8.58 4.31 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 K 8.48 4.25 0.00 1.76 1.79 0.00 1.74 0.00 0.00 1.76 0.00 0.00 3.02 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.41 1.42 7.81 80 Q 8.13 4.51 0.00 2.13 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.93 0.00 0.00 0.00 0.00 0.00 2.26 2.38 0.00 81 D 8.64 4.46 0.00 2.97 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 S 8.74 4.04 0.00 3.89 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 C 8.11 4.24 0.00 3.16 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 R 7.90 3.93 0.00 2.01 2.22 0.00 3.17 0.00 0.00 3.44 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.83 0.00 85 S 8.29 4.02 0.00 3.99 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 Q 8.42 3.94 0.00 1.99 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.59 0.00 0.00 0.00 0.00 0.00 2.58 2.47 0.00 87 L 7.71 3.72 0.00 1.76 1.80 0.24 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 88 C 7.68 2.74 0.00 2.22 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 E 7.90 3.78 0.00 2.10 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.42 0.00 90 C 7.89 4.21 0.00 3.20 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 D 7.89 3.94 0.00 2.77 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 K 8.22 3.71 0.00 1.61 1.88 0.00 1.58 0.00 0.00 1.73 0.00 0.00 2.90 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.36 1.39 7.81 93 A 7.89 3.89 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 A 7.70 3.54 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 A 8.33 3.69 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 T 7.84 3.77 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 97 C 7.91 4.18 0.00 3.02 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 F 8.08 4.61 0.00 3.03 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 A 8.00 4.07 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 R 8.22 4.24 0.00 1.80 2.01 0.00 3.09 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.80 0.00 101 N 7.82 5.09 0.00 2.92 2.82 0.00 0.00 6.51 6.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 K 8.08 4.15 0.00 1.89 1.84 0.00 1.63 0.00 0.00 1.63 0.00 0.00 2.81 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.43 1.38 7.81 103 T 8.09 3.95 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 104 T 7.64 4.47 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 105 Y 7.84 4.03 0.00 3.04 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 N 8.67 5.17 0.00 2.68 2.37 0.00 0.00 6.59 6.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 K 8.66 4.05 0.00 2.14 2.13 0.00 1.58 0.00 0.00 1.76 0.00 0.00 2.88 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.47 1.39 7.81 108 K 8.31 3.86 0.00 1.44 1.26 0.00 1.62 0.00 0.00 1.50 0.00 0.00 2.30 0.00 0.00 2.17 0.00 0.00 0.00 0.00 1.04 1.25 7.81 109 Y 7.28 4.64 0.00 1.76 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 Q 7.49 3.69 0.00 1.86 1.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.97 7.34 0.00 0.00 0.00 0.00 0.00 1.49 2.18 0.00 111 Y 7.39 5.09 0.00 3.07 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 Y 7.80 4.23 0.00 3.05 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 S 7.81 4.38 0.00 3.86 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 N 8.91 4.28 0.00 2.87 2.99 0.00 0.00 6.76 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 K 7.74 3.95 0.00 1.67 1.71 0.00 1.75 0.00 0.00 1.66 0.00 0.00 3.04 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.40 7.81 116 H 7.85 4.59 0.00 2.93 3.41 0.00 5.78 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 C 7.63 4.66 0.00 3.06 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 R 7.95 4.62 0.00 1.79 1.77 0.00 3.38 0.00 0.00 3.36 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.58 0.00 119 G 8.54 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 S 8.09 4.82 0.00 3.99 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 T 8.04 4.38 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 122 P 0.00 4.76 0.00 2.17 2.09 0.00 3.66 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 2.02 0.00 123 R 8.38 3.52 0.00 1.84 1.90 0.00 3.31 0.00 0.00 3.22 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.61 0.00 124 C 8.80 4.46 0.00 2.99 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00